4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[(4-chloro-2,5-dioxo-1-phenethyl-pyrrol-3-yl)amino]benzenesulfonamide CAS Name: 4-[(4-chloro-2,5-dioxo-1-phenethyl-3-pyrrolyl)amino]benzenesulfonamide IUPAC Name: 4-[(4-chloro-2,5-dioxo-1-phenethylpyrrol-3-yl)amino]benzenesulfonamide Traditional Name: 4-[(4-chloro-2,5-diketo-1-phenethyl-3-pyrrolin-3-yl)amino]benzenesulfonamide Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H16ClN3O4S/c19-15-16(21-13-6-8-14(9-7-13)27(20,25)26)18(24)22(17(15)23)11-10-12-4-2-1-3-5-12/h1-9,21H,10-11H2,(H2,20,25,26)